1,3-bis[(R)-butylsulfinyl]propan-2-yl benzoate

Systemtic Name: 1,3-bis[(R)-butylsulfinyl]propan-2-yl benzoate Openeye Name: [2-[(R)-butylsulfinyl]-1-[[(R)-butylsulfinyl]methyl]ethyl] benzoate CAS Name: benzoic acid 1,3-bis[(R)-butylsulfinyl]propan-2-yl ester IUPAC Name: 1,3-bis[(R)-butylsulfinyl]propan-2-yl benzoate Traditional Name: benzoic acid [2-[(R)-butylsulfinyl]-1-[[(R)-butylsulfinyl]methyl]ethyl] ester Formula: C18H28O4S2 MolecularWeight: 372.54252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)CC(CS(=O)CCCC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCC[S@@](=O)CC(C[S@](=O)CCCC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H28O4S2/c1-3-5-12-23(20)14-17(15-24(21)13-6-4-2)22-18(19)16-10-8-7-9-11-16/h7-11,17H,3-6,12-15H2,1-2H3/t23-,24-/m1/s1